SCHEMBL25422945

SCHEMBL25422945

C=C(C)C(=O)OC(C)OO

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.45
ALDH1A1 P00352 2/20 0.44
THRB P10828 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL538063 0.87 TSHR (0.50) TSHRALDH1A1THRBTDP1
SCHEMBL6904341 0.85 TSHR (0.48) TSHRALDH1A1THRBTDP1
SCHEMBL4096632 0.83 TSHR (0.46) TSHRALDH1A1THRBTDP1
SCHEMBL13126153 0.81 TSHR (0.45) TSHRALDH1A1THRBTDP1
SCHEMBL137981 0.81 ALDH1A1 (0.50) TSHRALDH1A1THRBTDP1
Methacrylic Acid SCHEMBL7644148 0.81 TSHR (0.45) TSHRALDH1A1THRBTDP1
SCHEMBL1419983 0.81 TSHR (0.46) TSHRALDH1A1THRBTDP1
SCHEMBL8598159 0.81 TSHR (0.45) TSHRALDH1A1THRBTDP1
SCHEMBL9249841 0.79 TSHR (0.44) TSHRALDH1A1THRBTDP1
SCHEMBL21831904 0.79 TSHR (0.43) TSHRALDH1A1THRBTDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4506429-A2 PRETREATMENT COMPOSITIONS BONDED TO METAL SUBSTRATES AND METHODS OF MAKING THE SAME Novelis Inc. (US) 2025-02-12 EP disclosed
EP-4165135-B1 PRETREATMENT COMPOSITIONS BONDED TO METAL SUBSTRATES AND METHODS OF MAKING THE SAME NOVELIS INC (US) 2024-11-27 EP disclosed
US-20230183517-A1 PRETREATMENT COMPOSITIONS BONDED TO METAL SUBSTRATES AND METHODS OF MAKING THE SAME NOVELIS INC. (US) 2023-06-15 US disclosed